| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2005 | 24 | Yes |
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 3.77 | 13.17 | -10.9 | 1 | 6 | 0 | 69 | 326.4 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.95 | 12.94 | -37.54 | 0 | 6 | -1 | 71 | 325.392 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.95 | 13.61 | -51.11 | 2 | 6 | 1 | 74 | 327.408 | 6 | ↓ |
